7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione

C16H19N5O3 — CID 56799693

IUPAC7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCn1c(=O)[nH]c(=O)c2ccc(C(=O)N3CCN(C4CC4)CC3)nc21
InChIInChI=1S/C16H19N5O3/c1-19-13-11(14(22)18-16(19)24)4-5-12(17-13)15(23)21-8-6-20(7-9-21)10-2-3-10/h4-5,10H,2-3,6-9H2,1H3,(H,18,22,24)
InChIKeyMFORJAZLJROPPN-UHFFFAOYSA-N
MW329.36 g/mol
LogP-0.46
Rot. Bonds2

About 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione

7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione (PubChem CID 56799693) has the molecular formula C16H19N5O3 and a molecular weight of 329.36 g/mol. Its IUPAC name is 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione.

Molecular Properties

Compound Name7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
PubChem CID56799693
Molecular FormulaC16H19N5O3
Molecular Weight329.36 g/mol
Exact Mass329.15
IUPAC Name7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione
SMILESCn1c(=O)[nH]c(=O)c2ccc(C(=O)N3CCN(C4CC4)CC3)nc21
InChIInChI=1S/C16H19N5O3/c1-19-13-11(14(22)18-16(19)24)4-5-12(17-13)15(23)21-8-6-20(7-9-21)10-2-3-10/h4-5,10H,2-3,6-9H2,1H3,(H,18,22,24)
InChIKeyMFORJAZLJROPPN-UHFFFAOYSA-N
XLogP-0.46
TPSA91.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
The IUPAC name of 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione (CID 56799693) is 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione.
What is the SMILES notation for 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
The canonical SMILES for 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione is Cn1c(=O)[nH]c(=O)c2ccc(C(=O)N3CCN(C4CC4)CC3)nc21.
What is the InChIKey of 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
The InChIKey is MFORJAZLJROPPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O3/c1-19-13-11(14(22)18-16(19)24)4-5-12(17-13)15(23)21-8-6-20(7-9-21)10-2-3-10/h4-5,10H,2-3,6-9H2,1H3,(H,18,22,24).
What are the key properties of 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione?
7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione has a molecular weight of 329.36 g/mol, XLogP of -0.46, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-cyclopropylpiperazine-1-carbonyl)-1-methylpyrido[2,3-d]pyrimidine-2,4-dione is sourced from PubChem (CID 56799693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).